| SpectraBase Spectrum ID |
3aplaBPYYpN |
| Name |
Ethyl 2-(2-Chloromethyl)-2,3,3a,4,5,6-Hexahydrobenzofuran-7-carboxylate isomer |
| Alternate Name(s) |
Ethyl 2-(chloromethyl)-2,3,3a,4,5,6-hexahydrobenzofuran-7-carboxylate
Ethyl 2-(chloromethyl)-2,3,3a,4,5,6-hexahydro-1-benzofuran-7-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H17ClO3 |
| InChI |
InChI=1S/C12H17ClO3/c1-2-15-12(14)10-5-3-4-8-6-9(7-13)16-11(8)10/h8-9H,2-7H2,1H3 |
| InChIKey |
KQPSQPUIHZYNQS-UHFFFAOYSA-N |
| Molecular Weight |
244.718 g/mol |
| SMILES |
C12=C(C(=O)OCC)CCCC2CC(O1)CCl |
| SPLASH |
splash10-06dj-0930000000-4abfe60f00aca5e15047 |
| Source of Spectrum |
F-70-10021-21 |
| Wiley ID |
1597902 |
